N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide

C21H25NO2 — CID 55587210

IUPACN-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide
SMILESCCN(C(=O)c1ccc(COc2ccccc2)cc1)C1CCCC1
InChIInChI=1S/C21H25NO2/c1-2-22(19-8-6-7-9-19)21(23)18-14-12-17(13-15-18)16-24-20-10-4-3-5-11-20/h3-5,10-15,19H,2,6-9,16H2,1H3
InChIKeyVNQQBDYFMPOQRX-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.67
Rot. Bonds6

About N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide

N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide (PubChem CID 55587210) has the molecular formula C21H25NO2 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide
PubChem CID55587210
Molecular FormulaC21H25NO2
Molecular Weight323.44 g/mol
Exact Mass323.19
IUPAC NameN-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide
SMILESCCN(C(=O)c1ccc(COc2ccccc2)cc1)C1CCCC1
InChIInChI=1S/C21H25NO2/c1-2-22(19-8-6-7-9-19)21(23)18-14-12-17(13-15-18)16-24-20-10-4-3-5-11-20/h3-5,10-15,19H,2,6-9,16H2,1H3
InChIKeyVNQQBDYFMPOQRX-UHFFFAOYSA-N
XLogP4.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-4-phenylmethoxybenzamide
CID 4958372
2-[methyl-[1-[4-(phenoxymethyl)benzoyl]azepan-4-yl]amino]acetic acid
CID 129008282
N-cyclohexyl-4-(phenoxymethyl)benzamide
CID 40606245
ethane;4-(phenoxymethyl)benzoic acid;propane
CID 144638943
N-cyclohexyl-4-(difluoromethoxy)-N-ethylbenzamide
CID 78805547
4-ethoxy-N-ethyl-N-piperidin-3-ylbenzamide
CID 60807243
N,N-dicyclohexyl-4-ethoxybenzamide
CID 4227580
N-cyclopentyl-N-ethyl-4-(methylamino)benzamide
CID 62169892
(2-ethylpiperidin-1-yl)-[4-(phenoxymethyl)phenyl]methanone
CID 55334521
2-[acetyl(cyclopentyl)amino]-N-(4-phenylmethoxyphenyl)acetamide
CID 113159367
N-(1-aminopropan-2-yl)-N-methyl-4-(phenoxymethyl)benzamide
CID 119582860
4-[3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)propoxy]-N-cyclopentyl-N-ethylbenzamide;oxalic acid
CID 69065089

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide?
The IUPAC name of N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide (CID 55587210) is N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide is CCN(C(=O)c1ccc(COc2ccccc2)cc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide?
The InChIKey is VNQQBDYFMPOQRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO2/c1-2-22(19-8-6-7-9-19)21(23)18-14-12-17(13-15-18)16-24-20-10-4-3-5-11-20/h3-5,10-15,19H,2,6-9,16H2,1H3.
What are the key properties of N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide?
N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide has a molecular weight of 323.44 g/mol, XLogP of 4.67, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-4-(phenoxymethyl)benzamide is sourced from PubChem (CID 55587210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).